N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.4857 | 0.2738 | 0.8952 | 0.0000 | Cu |
2 | 0.2500 | 0.2500 | 0.6985 | 0.0000 | Cu |
3 | 0.0000 | 0.0000 | 0.0000 | 0.0000 | Cu |
4 | 0.2500 | 0.2500 | 0.9960 | 0.0000 | Te |
5 | 0.5681 | 0.9937 | 0.8525 | 0.0000 | S |
6 | 0.7500 | 0.2500 | 0.0000 | 0.0000 | S |
7 | 0.4255 | 0.9544 | 0.8381 | 0.0000 | O |
8 | 0.6624 | 0.9297 | 0.8089 | 0.0000 | O |
9 | 0.5844 | 0.1421 | 0.8437 | 0.0000 | O |
10 | 0.6024 | 0.9560 | 0.9202 | 0.0000 | O |
11 | 0.6545 | 0.3294 | 0.9601 | 0.0000 | O |
12 | 0.3655 | 0.3912 | 0.9499 | 0.0000 | O |
13 | 0.7500 | 0.2500 | 0.7500 | 0.0000 | K |
14 | 0.2500 | 0.2500 | 0.8225 | 0.0000 | (Cl) |